N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C22H26N4O3 — CID 109074679

About N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109074679) has the molecular formula C22H26N4O3 and a molecular weight of 394.48 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
• PubChem CID: 109074679
• Molecular Formula: C22H26N4O3
• Molecular Weight: 394.48 g/mol
• Exact Mass: 394.20
• IUPAC Name: N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
• SMILES: CC(=O)c1cccc(NC(=O)c2nc(C(=O)N3CCCCC3)n3c2CCCC3)c1
• InChI: InChI=1S/C22H26N4O3/c1-15(27)16-8-7-9-17(14-16)23-21(28)19-18-10-3-6-13-26(18)20(24-19)22(29)25-11-4-2-5-12-25/h7-9,14H,2-6,10-13H2,1H3,(H,23,28)
• InChIKey: IYJXAQIQYRJGAI-UHFFFAOYSA-N
• XLogP: 3.30
• TPSA: 84.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	394.48
LogP ≤ 5	3.30
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The IUPAC name of N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 109074679) is N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

What is the SMILES notation for N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The canonical SMILES for N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is CC(=O)c1cccc(NC(=O)c2nc(C(=O)N3CCCCC3)n3c2CCCC3)c1.

What is the InChIKey of N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The InChIKey is IYJXAQIQYRJGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3/c1-15(27)16-8-7-9-17(14-16)23-21(28)19-18-10-3-6-13-26(18)20(24-19)22(29)25-11-4-2-5-12-25/h7-9,14H,2-6,10-13H2,1H3,(H,23,28).

What are the key properties of N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-acetylphenyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109074679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).